Geometry & MOs

Info

ID:	335720
PubChem CID:	127254582
Reduced:	ClFNO4H23C34 (1)
Stoich.:	ABCD4E23F34 (1)
Weight, g/mol:	352.226312
ΔH_f, kcal/mol:	-63.05
Dipole, Da:	6.55
IP(EA), eV:	-8.68(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-6-pyrrol-1-ylhexanamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@H]2[C@@H](N3C(C24C(=O)C5=CC=CC=C5C4=O)C=CC6=C3C=CC(=C6)F)C(=O)C7=CC=C(C=C7)Cl

DOS

IR

Vibrations